Products Categories
| CAS No.: | 37777-68-7 |
|---|---|
| Name: | 4-CHLORO-3-NITROPHENYLACETIC ACID |
| Article Data: | 2 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H6ClNO4 |
| Molecular Weight: | 215.59 |
| Synonyms: | 3-Nitro-4-chlorophenylacetic acid;TL8002775; |
| Density: | 1.533 g/cm3 |
| Melting Point: | 106.0 to 110.0 °C |
| Boiling Point: | 401.587 °C at 760 mmHg |
| Flash Point: | 196.673 °C |
| PSA: | 83.12000 |
| LogP: | 2.39850 |
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 43224-75-52,2,6,6-Tetramethyl-4-(2-propyleneoxy) Piperidine
What can I do for you?
Get Best Price
Specification
The Benzeneaceticacid, 4-chloro-3-nitro-, with the CAS registry number 37777-68-7, is also known as 3-nitro-4-chlorophenylacetic acid. It belongs to Aromatic Phenylacetic Acids and Derivatives; Pharmacetical; Organic acids. This chemical's molecular formula is C8H6ClNO4 and molecular weight is 215.59. What's more, its IUPAC name is called 2-(4-chloro-3-nitrophenyl)acetic acid.
Physical properties of Benzeneaceticacid, 4-chloro-3-nitro- are: (1)ACD/LogP: 1.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.03; (4)ACD/LogD (pH 7.4): -1.68; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.62; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 72.12 Å2; (13)Index of Refraction: 1.61; (14)Molar Refractivity: 48.8 cm3; (15)Molar Volume: 140.6 cm3; (16)Surface Tension: 63.4 dyne/cm; (17)Density: 1.532 g/cm3; (18)Flash Point: 196.7 °C; (19)Enthalpy of Vaporization: 68.82 kJ/mol; (20)Boiling Point: 401.6 °C at 760 mmHg; (21)Vapour Pressure: 3.6E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])Cl
(2)InChI: InChI=1S/C8H6ClNO4/c9-6-2-1-5(4-8(11)12)3-7(6)10(13)14/h1-3H,4H2,(H,11,12)
(3)InChIKey: WUXCECMNMNJYSC-UHFFFAOYSA-N